Reaction Details Report a problem with these data
Target
Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific)
Ligand
BDBM50458053
Substrate
n/a
Meas. Tech.
ChEMBL_1761930 (CHEMBL4197177)
IC50
38000±n/a nM
Citation
 Elsebaei, MM; Mohammad, H; Abouf, M; Abutaleb, NS; Hegazy, YA; Ghiaty, A; Chen, L; Zhang, J; Malwal, SR; Oldfield, E; Seleem, MN; Mayhoub, AS Alkynyl-containing phenylthiazoles: Systemically active antibacterial agents effective against methicillin-resistant Staphylococcus aureus (MRSA). Eur J Med Chem 148:195-209 (2018) [PubMed]  Article 
Target
Name:
Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific)
Synonyms:
2.5.1.31 | Ditrans,polycis-undecaprenylcistransferase | UDS | UPP synthase | UPPS_ECOLI | Undecaprenyl diphosphate synthase | Undecaprenyl pyrophosphate synthase | ispU | rth | uppS | yaeS
Type:
PROTEIN
Mol. Mass.:
28445.82
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_117825
Residue:
253
Sequence:
MMLSATQPLSEKLPAHGCRHVAIIMDGNGRWAKKQGKIRAFGHKAGAKSVRRAVSFAANNGIEALTLYAFSSENWNRPAQEVSALMELFVWALDSEVKSLHRHNVRLRIIGDTSRFNSRLQERIRKSEALTAGNTGLTLNIAANYGGRWDIVQGVRQLAEKVQQGNLQPDQIDEEMLNQHVCMHELAPVDLVIRTGGEHRISNFLLWQIAYAELYFTDVLWPDFDEQDFEGALNAFANRERRFGGTEPGDETA
  
Inhibitor
Name:
BDBM50458053
Synonyms:
CHEMBL4214440
Type:
Small organic molecule
Emp. Form.:
C18H19N5S
Mol. Mass.:
337.442
SMILES:
C\C(=N/NC(N)=N)c1sc(nc1C)-c1ccc(cc1)C#CC1CC1
Structure:
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